N-[4-(acridin-9-ylamino)phenyl]-3-(quinolin-4-ylamino)propane-1-sulfonamide dihydrobromide

Systemtic Name: N-[4-(acridin-9-ylamino)phenyl]-3-(quinolin-4-ylamino)propane-1-sulfonamide dihydrobromide Openeye Name: N-[4-(acridin-9-ylamino)phenyl]-3-(4-quinolylamino)propane-1-sulfonamide dihydrobromide CAS Name: N-[4-(9-acridinylamino)phenyl]-3-(4-quinolinylamino)-1-propanesulfonamide dihydrobromide IUPAC Name: N-[4-(acridin-9-ylamino)phenyl]-3-(quinolin-4-ylamino)propane-1-sulfonamide dihydrobromide Traditional Name: N-[4-(acridin-9-ylamino)phenyl]-3-(4-quinolylamino)propane-1-sulfonamide dihydrobromide Formula: C31H29Br2N5O2S MolecularWeight: 695.46726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NCCCS(=O)(=O)NC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64.Br.Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NCCCS(=O)(=O)NC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64.Br.Br

InChI

InChI=1S/C31H27N5O2S.2BrH/c37-39(38,21-7-19-32-28-18-20-33-27-11-4-1-8-24(27)28)36-23-16-14-22(15-17-23)34-31-25-9-2-5-12-29(25)35-30-13-6-3-10-26(30)31;;/h1-6,8-18,20,36H,7,19,21H2,(H,32,33)(H,34,35);2*1H